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gpaw
Merge requests
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104
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2,011
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202
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Updated date
WIP: Second-order imaginary part to the dielectric function
gpaw!256
· created
Sep 04, 2017
by
Henrik Weyer
Response
Closed
5
updated
Oct 03, 2023
Draft: Refactor basis generation
gpaw!853
· created
May 25, 2021
by
Ask Hjorth Larsen
Closed
1
updated
Oct 03, 2023
Draft: Cuda branch
gpaw!856
· created
Jun 02, 2021
by
Ask Hjorth Larsen
Closed
1
updated
Oct 03, 2023
Draft: Towards reusing wavefunctions when cell changes
gpaw!859
· created
Jun 06, 2021
by
Ask Hjorth Larsen
Closed
1
updated
Oct 03, 2023
Draft: cupy-compatible DielectricFunctionCalculator
gpaw!1293
· created
Oct 06, 2022
by
Ask Hjorth Larsen
Closed
4
1
updated
Oct 03, 2023
WIP: Update mgga.py - always use VASP-style regularization
gpaw!182
· created
Feb 18, 2017
by
Rasmus K
Closed
2
updated
Oct 03, 2023
Draft: avoid np.seterr() in fxc
gpaw!1476
· created
Jan 23, 2023
by
Ask Hjorth Larsen
Closed
7
updated
Oct 03, 2023
update test after rename of variable
gpaw!1869
· created
Aug 24, 2023
by
Ask Hjorth Larsen
Closed
1
updated
Oct 03, 2023
WIP: New defect module
gpaw!592
· created
Nov 13, 2019
by
Kristen Kaasbjerg
Closed
updated
Oct 03, 2023
Draft: demonstration of possible temporary bridge between CPU and GPU arrays
gpaw!1295
· created
Oct 10, 2022
by
Mikael Kuisma
Closed
1
updated
Oct 03, 2023
WIP: Make the response module work with non-collinear ground states
gpaw!434
· created
Oct 19, 2018
by
Morten Gjerding
Response
Closed
1
updated
Oct 03, 2023
Draft: Improve LCAOTDDFT replay
gpaw!426
· created
Sep 17, 2018
by
Tuomas Rossi
Closed
3
updated
Oct 04, 2023
run on "run:staging" image
gpaw!1873
· created
Aug 25, 2023
by
Ask Hjorth Larsen
Closed
4
updated
Oct 04, 2023
Add missing spin dimension in gw eigenvalue handling
gpaw!2020
· created
Oct 13, 2023
by
Stefan Mattsson
Closed
updated
Oct 13, 2023
Draft: Break g0w0 anisotropy test
gpaw!2116
· created
Dec 04, 2023
by
John Mangeri
Response
Closed
1
updated
Dec 04, 2023
Draft: PAW ALDA goldstone scaling
gpaw!2174
· created
Feb 23, 2024
by
Thorbjørn Skovhus
Response
Closed
1
updated
Mar 05, 2024
Basic GPU handling and simple CI test for GPUs
gpaw!1323
· created
Oct 26, 2022
by
Martti Louhivuori
GPU
Closed
18
updated
Mar 15, 2024
Moved the PAW pair density calculations to a new class, where the FFBT...
gpaw!2202
· created
Mar 12, 2024
by
Mikkel Ohm Sauer
Response
Sprint
in progress
Closed
4
updated
Mar 20, 2024
Implements check that grid is compatible with fractional translations.
gpaw!2229
· created
Mar 26, 2024
by
JakobKSvaneborg
Closed
updated
Mar 27, 2024
DRAFT: BUGFIX: Remove error message with PBC + planewave + dipole.
gpaw!2288
· created
May 07, 2024
by
Andrew Peterson
Closed
3
updated
May 08, 2024
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